SCHEMBL855189

SCHEMBL855189

COC(=O)[C@H]1C(C(=O)Nc2ccc(Br)cc2C)[C@@H]2C=C[C@H]1C21CC1

nearest known ligand 0.61

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 17/20 0.61
FPR3 P25089 13/20 0.61
PKM P14618 1/20 0.50
HPGD P15428 1/20 0.46
HTT P42858 1/20 0.46

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2682432 1.00 FPR2 (0.61) FPR2FPR3PKMHPGDHTT
SCHEMBL2682272 0.88 FPR2 (0.66) FPR2FPR3PKMHPGDHTT
SCHEMBL857602 0.88 FPR2 (0.66) FPR2FPR3PKMHPGDHTT
SCHEMBL855247 0.88 FPR2 (0.60) FPR2FPR3
SCHEMBL2683402 0.88 FPR2 (0.60) FPR2FPR3
SCHEMBL2682405 0.82 FPR2 (0.74) FPR2FPR3
SCHEMBL2682240 0.80 FPR2 (0.60) FPR2FPR3PKM
SCHEMBL856281 0.80 FPR2 (0.60) FPR2FPR3PKM
SCHEMBL2683985 0.78 FPR2 (0.59) FPR2FPR3
SCHEMBL856665 0.78 FPR2 (0.59) FPR2FPR3

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2432760-A1 BRIDGED SPIRO [2.4]HEPTANE DERIVATIVES AS ALX RECEPTOR AND/OR FPRL2 AGONISTS Actelion Pharmaceuticals Ltd. (CH) 2012-03-28 EP disclosed